SCHEMBL2170699

SCHEMBL2170699

CCOC(=O)C(C)O/N=C\c1cc(Br)c(Oc2ccc(OC)c(CC)c2)c(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 2/20 0.40
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 6/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
RECQL P46063 1/20 0.38
POLB P06746 2/20 0.37
PTPN1 P18031 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HTT P42858 2/20 0.36
HPGD P15428 3/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
FDPS P14324 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2170701 1.00 TNFRSF1A (0.40) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2169802 0.90 LMNA (0.41) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL16495653 0.90 LMNA (0.41) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2170309 0.89 THRB (0.46) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL16496217 0.89 THRB (0.46) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2169404 0.88 MAPK1 (0.41) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2169973 0.88 MAPK1 (0.41) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2170982 0.88 TNFRSF1A (0.41) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2169175 0.88 TNFRSF1A (0.39) TNFRSF1AMAPK1HSD17B10LMNAMAPT
SCHEMBL2169177 0.88 TNFRSF1A (0.39) TNFRSF1AMAPK1HSD17B10LMNAMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301200-A1 THYROID RECEPTOR LIGANDS CADILA HEALTHCARE LIMITED (IN) 2011-12-08 US claimed
EP-2346814-A2 THYROID RECEPTOR LIGANDS Cadila Healthcare Limited (IN) 2011-07-27 EP claimed
WO-2010049946-A2 THYROID RECEPTOR LIGANDS CADILA HEALTHCARE LIMITED (IN) 2010-05-06 WO claimed
US-20110301200-A1 THYROID RECEPTOR LIGANDS CADILA HEALTHCARE LIMITED (IN) 2011-12-08 US disclosed
EP-2346814-A2 THYROID RECEPTOR LIGANDS Cadila Healthcare Limited (IN) 2011-07-27 EP disclosed
WO-2010049946-A2 THYROID RECEPTOR LIGANDS CADILA HEALTHCARE LIMITED (IN) 2010-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110301200-A1 THYROID RECEPTOR LIGANDS TSHR, THRB, THRA TNFRSF1A 401/4885MAPK1 2130/4885HSD17B10 911/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.